5-cyclopropyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-2-phenyl-pyrazole-3-carboxamide

Systemtic Name: 5-cyclopropyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-2-phenyl-pyrazole-3-carboxamide Openeye Name: 5-cyclopropyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]-2-phenyl-pyrazole-3-carboxamide CAS Name: 5-cyclopropyl-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-2-phenyl-3-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-2-phenylpyrazole-3-carboxamide Traditional Name: 5-cyclopropyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]-2-phenyl-pyrazole-3-carboxamide Formula: C23H26N5O2+ MolecularWeight: 404.48484

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN(C(=C2)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4)C5=CC=CC=C5

Isomeric SMILES

C1CC1C2=NN(C(=C2)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4)C5=CC=CC=C5

InChI

InChI=1S/C23H25N5O2/c29-23(25-16-17-6-9-22(24-15-17)27-10-12-30-13-11-27)21-14-20(18-7-8-18)26-28(21)19-4-2-1-3-5-19/h1-6,9,14-15,18H,7-8,10-13,16H2,(H,25,29)/p+1